SCHEMBL2773240

SCHEMBL2773240

O=C(O)NCC(=O)N1CCC(Oc2ccc(F)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 4/20 0.53
MLNR O43193 2/20 0.49
ADRB2 P07550 1/20 0.48
SCD O00767 1/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
POLB P06746 1/20 0.46
PLA2G1B P04054 1/20 0.44
ATG4B Q9Y4P1 1/20 0.44
MAPT P10636 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
LIPE Q05469 1/20 0.43

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6443537 0.81 MLNR (0.55) EPHX2MLNRADRB2KMT2AMEN1
SCHEMBL27900122 0.81 ADRB2 (0.53) EPHX2MLNRADRB2PLA2G1BATG4B
Hydrochloric Acid SCHEMBL27826424 0.80 MLNR (0.52) EPHX2MLNRADRB2KMT2AMEN1
SCHEMBL4578888 0.79 ADRB2 (0.52) EPHX2MLNRADRB2PLA2G1BATG4B
SCHEMBL14412954 0.78 EPHX2 (0.62) EPHX2MLNRADRB2KMT2AMEN1
SCHEMBL2776649 0.78 EPHX2 (0.47) EPHX2MLNRADRB2POLBL3MBTL1
SCHEMBL2774350 0.78 SCD (0.46) EPHX2MLNRSCD
SCHEMBL5210775 0.77 EPHX2 (0.51) EPHX2MLNRADRB2PLA2G1BATG4B
SCHEMBL7092551 0.76 EPHX2 (0.57) EPHX2KMT2AMEN1
SCHEMBL14412779 0.76 EPHX2 (0.57) EPHX2MLNRADRB2PLA2G1BATG4B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2258697-A1 HYDROXYQUINOXALINECARBOXAMIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2010-12-08 EP disclosed